| SpectraBase Compound ID | DLXemqEG3cJ |
|---|---|
| InChI | InChI=1S/C24H22/c1-4-11-21(12-5-1)15-10-18-24(23-16-8-3-9-17-23)20-19-22-13-6-2-7-14-22/h1-9,11-14,16-17,24H,10,15,18H2 |
| InChIKey | ICLVTJNRXKFZQI-UHFFFAOYSA-N |
| Mol Weight | 310.44 g/mol |
| Molecular Formula | C24H22 |
| Exact Mass | 310.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I5oUWzZ1Pr1 |
|---|---|
| Name | 3,5-Hexadien-1-in, 1,3,6-triphenyl-, (Z,E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.172150708 u |
| Formula | C24H22 |
| InChI | InChI=1S/C24H22/c1-4-11-21(12-5-1)15-10-18-24(23-16-8-3-9-17-23)20-19-22-13-6-2-7-14-22/h1-9,11-14,16-17,24H,10,15,18H2 |
| InChIKey | ICLVTJNRXKFZQI-UHFFFAOYSA-N |
| Molecular Weight | 310.440 g/mol |
| Nominal Mass | 310 u |
| SMILES | C(c1ccccc1)#CC(CCCc1ccccc1)c1ccccc1 |